cxypay0241
     RDKit          3D

 41 45  0  0  1  0  0  0  0  0999 V2000
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   -5.2817    2.7943   -0.8969 C   0  0  0  0  0  3  0  0  0  0  0  0
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   -4.6906    2.5268    1.5653 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.7907    1.6186    0.9932 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4937   -0.1534   -0.4214 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.1642    1.6451    1.3820 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3410    1.6218   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9212    0.8815   -0.3253 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3012    1.0113    1.8973 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.4948    1.0254    0.3296 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2644    0.6340   -0.7152 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.1191   -0.7684    0.2704 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.2596   -0.6840   -1.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.4760    3.8667    0.8819 O   0  0  0  0  0  1  0  0  0  0  0  0
   -4.1401    2.0946   -1.2936 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6575    2.8283    1.8642 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4250    2.8125   -0.6277 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5936    1.9312    0.3440 O   0  0  0  0  0  1  0  0  0  0  0  0
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   -4.7593    2.7651    3.0015 N   0  0  0  0  0  1  0  0  0  0  0  0
   -4.0398    0.1919   -0.5459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0689   -4.5068    0.5625 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2799   -5.5253    1.6023 N   0  0  0  0  0  1  0  0  0  0  0  0
   -2.5577   -3.0016   -2.1973 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.9534   -1.0372   -2.3393 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4427   -2.8456   -1.9686 O   0  0  0  0  0  1  0  0  0  0  0  0
   -4.6443   -4.7616    1.1823 O   0  0  0  0  0  1  0  0  0  0  0  0
  2  1  1  0
  2  3  1  0
  2 29  1  0
  3  6  1  0
  3 28  1  0
  4 30  1  0
  5  7  1  0
  5 29  1  0
  5 33  1  0
  5 35  1  1
  6  7  1  0
  6 34  1  0
  8 15  1  0
  8 16  1  0
  8 33  1  0
  9 12  2  0
  9 13  1  0
  9 30  1  0
 10 13  1  0
 10 14  1  0
 10 31  2  0
 11 14  2  0
 11 15  1  0
 11 32  1  0
 12 17  1  0
 13 18  2  0
 14 19  1  0
 15 20  2  0
 16 21  1  0
 17 22  2  0
 18 22  1  0
 18 23  1  0
 19 23  1  0
 19 24  2  0
 20 24  1  0
 20 25  1  0
 21 25  1  0
 21 26  1  0
 21 38  1  6
 23 39  2  0
 24 40  1  0
 26 27  1  0
 26 36  2  0
 27 41  1  0
 36 37  1  0
M  RAD  8   1   2   2   2   3   2   4   2   6   2   7   3   8   2  12   2
M  RAD  8  16   3  17   2  22   2  25   3  27   3  28   2  32   2  34   3
M  RAD  4  37   3  38   2  40   2  41   2
M  END
$$$$
